N2-(4-azanyl-3-methyl-phenyl)-6-heptyl-5-methyl-benzene-1,2,4-triamine

Systemtic Name: N2-(4-azanyl-3-methyl-phenyl)-6-heptyl-5-methyl-benzene-1,2,4-triamine Openeye Name: N2-(4-amino-3-methyl-phenyl)-6-heptyl-5-methyl-benzene-1,2,4-triamine CAS Name: N2-(4-amino-3-methylphenyl)-6-heptyl-5-methylbenzene-1,2,4-triamine IUPAC Name: 2-N-(4-amino-3-methylphenyl)-6-heptyl-5-methylbenzene-1,2,4-triamine Traditional Name: (4-amino-3-methyl-phenyl)-(2,5-diamino-3-heptyl-4-methyl-phenyl)amine Formula: C21H32N4 MolecularWeight: 340.50558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(C(=CC(=C1N)NC2=CC(=C(C=C2)N)C)N)C

Isomeric SMILES

CCCCCCCC1=C(C(=CC(=C1N)NC2=CC(=C(C=C2)N)C)N)C

InChI

InChI=1S/C21H32N4/c1-4-5-6-7-8-9-17-15(3)19(23)13-20(21(17)24)25-16-10-11-18(22)14(2)12-16/h10-13,25H,4-9,22-24H2,1-3H3